Acetamide, 2-((4-cyano-5-(((4-fluorophenyl)methyl)thio)-3-isothiazolyl)thio)-

Base Information

Chemical Name:Acetamide, 2-((4-cyano-5-(((4-fluorophenyl)methyl)thio)-3-isothiazolyl)thio)-
CAS No.:135489-19-9
Molecular Formula:C₁₃H₁₀FN₃OS₃
Molecular Weight:339.438
Hs Code.:
DSSTox Substance ID:DTXSID70159418
Wikidata:Q83027744

Synonyms:BRN 4269231;Acetamide, 2-((4-cyano-5-(((4-fluorophenyl)methyl)thio)-3-isothiazolyl)thio)-;2-((4-Cyano-5-(((4-fluorophenyl)methyl)thio)-3-isothiazolyl)thio)acetamide;135489-19-9;DTXSID70159418;LS-8721

Suppliers and Price of Acetamide, 2-((4-cyano-5-(((4-fluorophenyl)methyl)thio)-3-isothiazolyl)thio)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of Acetamide, 2-((4-cyano-5-(((4-fluorophenyl)methyl)thio)-3-isothiazolyl)thio)-

Chemical Property:

Vapor Pressure:4.21E-09mmHg at 25°C
Boiling Point:472.6°Cat760mmHg
Flash Point:239.6°C
Density:1.5g/cm³
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:338.99700363
Heavy Atom Count:21
Complexity:409

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1CSC2=C(C(=NS2)SCC(=O)N)C#N)F

Technology Process of Acetamide, 2-((4-cyano-5-(((4-fluorophenyl)methyl)thio)-3-isothiazolyl)thio)-

There total 1 articles about Acetamide, 2-((4-cyano-5-(((4-fluorophenyl)methyl)thio)-3-isothiazolyl)thio)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 3-Carbamoylmethylsulfanyl-4-cyano-isothiazole-5-thiol anion

: 135489-19-9
2-[4-Cyano-5-(4-fluoro-benzylsulfanyl)-isothiazol-3-ylsulfanyl]-acetamide

Guidance literature:: Yield given;

Reference yield: 75.0%

: 135489-19-9
2-[4-Cyano-5-(4-fluoro-benzylsulfanyl)-isothiazol-3-ylsulfanyl]-acetamide

: 135518-33-1
4-Amino-3-(4-fluoro-benzylsulfanyl)-thieno[2,3-c]isothiazole-5-carboxylic acid amide

Guidance literature:: With sodium ethanolate;

Reference yield:

: 135489-19-9
2-[4-Cyano-5-(4-fluoro-benzylsulfanyl)-isothiazol-3-ylsulfanyl]-acetamide

: 135489-01-9
8-(4-Fluoro-benzylsulfanyl)-isothiazolo[4',3':4,5]thieno[3,2-d][1,2,3]triazin-4-ol

Guidance literature:: Multi-step reaction with 2 steps

1: 75 percent / EtONa

2: 80 percent / NaNO₂, H₂SO₄ / acetic acid / 2 h

With sulfuric acid; sodium ethanolate; sodium nitrite; In acetic acid;